ArticleNature communications2023
Multi-step nucleation pathway of C-S-H during cement hydration from atomistic simulations.
Article in Nature communications, 2023. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 8 papers.
What it found
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Who cites it
8 citing papers in PubMed.
- Article
- Additive-specific modulation of non-classical nucleation pathways.Nature communications · 2026Article
- Real-time concrete strength monitoring using piezoelectric sensors and deep learning.Nature communications · 2025Article
- Formation Mechanism and Resulting Physical Properties of Colloidal Calcium Silicate Hydrates.Langmuir : the ACS journal of surfaces and colloids · 2025Review
- Structuring lightweight concrete with core-shell FeRSC advances · 2025Article
- Nature-inspired hierarchical building materials with low CONature communications · 2025Article
- Molecular elucidation of cement hydration inhibition by silane coupling agents.Nature communications · 2025Article
- Exploring the Potential of Nonclassical Crystallization Pathways to Advance Cementitious Materials.Chemical reviews · 2024Review
Corrections and comments
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Authors and funding
4 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
The Calcium Silicate Hydrate (C-S-H) nucleation is a crucial step during cement hydration and determines to a great extent the rheology, microstructure, and properties of the cement paste. Recent evidence indicates that the C-S-H nucleation involves at least two steps, yet the underlying atomic scale mechanism, the nature of the primary particles and their stability, or how they merge/aggregate to form larger structures is unknown. In this work, we use atomistic simulation methods, specifically DFT, evolutionary algorithms (EA), and Molecular Dynamics (MD), to investigate the structure and formation of C-S-H primary particles (PPs) from the ions in solution, and then discuss a possible formation pathway for the C-S-H nucleation. Our simulations indicate that even for small sizes the most stable clusters encode C-S-H structural motifs, and we identified a C
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Registered trials
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